SCHEMBL7596514

SCHEMBL7596514

CCOC(=O)O[C@]1(C(=O)CO)CC[C@H]2[C@@H]3C[C@H](C)C4=CC(=O)C=C[C@]4(C)[C@H]3C(O)C[C@@]21C

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PGR P06401 7/20 0.69
▸ NR3C1 P04150 7/20 0.69
▸ CYP3A4 P08684 5/20 0.69
▸ HIF1A Q16665 5/20 0.69
▸ ABCB11 O95342 3/20 0.69
▸ HSD17B10 Q99714 3/20 0.69
▸ NR1I2 O75469 2/20 0.69
▸ ALDH1A1 P00352 1/20 0.69
▸ ABCC4 O15439 1/20 0.69
▸ PDE4D Q08499 1/20 0.69
▸ AR P10275 3/20 0.62
▸ F2 P00734 1/20 0.62
▸ USP2 O75604 1/20 0.61
▸ LMNA P02545 1/20 0.61
▸ CYP2D6 P10635 1/20 0.61
▸ CYP2C9 P11712 1/20 0.61
▸ ABCC3 O15438 1/20 0.59
▸ NR3C2 P08235 5/20 0.49
▸ TNF P01375 1/20 0.49
▸ IL6 P05231 1/20 0.49

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL8918368 0.94 PGR (0.67) PGRNR3C1CYP3A4HIF1AABCB11
SCHEMBL11422613 0.93 PGR (0.67) PGRNR3C1CYP3A4HIF1AABCB11
SCHEMBL7598319 0.91 PGR (0.61) PGRNR3C1CYP3A4HIF1AABCB11
SCHEMBL11421536 0.91 PGR (0.76) PGRNR3C1CYP3A4HIF1AABCB11
SCHEMBL11422610 0.91 PGR (0.65) PGRNR3C1CYP3A4HIF1AABCB11
SCHEMBL10904456 0.90 PGR (0.71) PGRNR3C1CYP3A4HIF1AABCB11
SCHEMBL6856651 0.90 PGR (0.71) PGRNR3C1CYP3A4HIF1AABCB11
SCHEMBL6856646 0.90 PGR (0.71) PGRNR3C1CYP3A4HIF1AABCB11
SCHEMBL10527423 0.90 PGR (0.71) PGRNR3C1CYP3A4HIF1AABCB11
SCHEMBL11878266 0.90 CYP3A4 (0.73) PGRNR3C1CYP3A4HIF1AABCB11

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0640616-B1 17-Alkylcarbonate, 21-0-carbonic/carboxylic acid esters of corticosteroids, a method for their production and pharmaceutical compositions containing them HOECHST AG (DE) 2002-11-27 — — EP disclosed
US-5608093-A ANTIINFLAMMATORY AGENTS HOECHST AKTIENGESELLSCHAFT (DE) 1997-03-04 — — US disclosed
EP-0640616-A2 17-Alkylcarbonate, 21-0-carbonic/carboxylic acid esters of corticosteroids, a method for their production and pharmaceutical compositions containing them HOECHST AKTIENGESELLSCHAFT (DE) 1995-03-01 — — EP disclosed
US-4242334-A ANTIINFLAMMATORY AGENTS; SKIN DISORDERS HOECHST AKTIENGESELLSCHAFT (DE) 1980-12-30 — — US disclosed
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